SpectraBase Compound ID | GCg42yowpIE |
---|---|
InChI | InChI=1S/C6H10O2/c1-5(7)8-4-6-2-3-6/h6H,2-4H2,1H3 |
InChIKey | WIJKCDNTPKNICK-UHFFFAOYSA-N |
Mol Weight | 114.14 g/mol |
Molecular Formula | C6H10O2 |
Exact Mass | 114.06808 g/mol |
SpectraBase Spectrum ID | BHSJPHDBu8H |
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Name | Cyclopropylmethanol acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 114.068079560 u |
Formula | C6H10O2 |
InChI | InChI=1S/C6H10O2/c1-5(7)8-4-6-2-3-6/h6H,2-4H2,1H3 |
InChIKey | WIJKCDNTPKNICK-UHFFFAOYSA-N |
Molecular Weight | 114.144 g/mol |
SMILES | C(OC(=O)C)C1CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963258 |